COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK342459
Chemical Name: 2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-N-[3-nitro-5-(pyridin-3-yloxy)phenyl]acetamide
Smiles: O=C(Cn1nc(c(c1C)[N+](=O)[O-])[N+](=O)[O-])Nc1cc(Oc2cccnc2)cc(c1)[N+](=O)[O-]

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Molecular Weight: 443.33
Empirical Formula: C17H13N7O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.036
Rotatable bonds: 4
H-donors: 1
H-acceptors: 8
PSA: 206
Number of rings: 3

     

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